Structure Database (LMSD)

Common Name
4Z-Decenal
Systematic Name
4Z-Decenal
Synonyms
LM ID
LMFA06000147
Formula
C10H18O
Exact Mass
Calculate m/z
154.135765
Sum Composition
FAL 10:1
Status
Curated
Show lipids differing only in stereochemistry/bond geometry
View NP-MRD ID(NMR) spectrum

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty aldehydes [FA06]

References

Comments
Pherobase

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Eocanthecona furcellata (#696902)
Insecta (#50557)
Semiochemicals from the predatory stink bug Eocanthecona furcellata (Wolff): components of metathoracic gland, dorsal abdominal gland, and sternal gland secretions.,
J Chem Ecol, 2003
Pubmed ID: 14584678

String Representations

InChiKey (Click to copy)
CWRKZMLUDFBPAO-SREVYHEPSA-N
InChi (Click to copy)
InChI=1S/C10H18O/c1-2-3-4-5-6-7-8-9-10-11/h6-7,10H,2-5,8-9H2,1H3/b7-6-
SMILES (Click to copy)
C(CC/C=C\CCCCC)(=O)[H]

Other Databases

HMDB ID
HMDB0041014
CHEBI ID
90056
PubChem CID
5362620

Calculated Physicochemical Properties

Heavy Atoms 11
Rings 0
Aromatic Rings 0
Rotatable Bonds 7
Van der Waals Molecular Volume 185.07
Topological Polar Surface Area 17.07
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 1
logP 3.10
Molar Refractivity 48.58

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Created at
-
Updated at
23rd Dec 2024